5-[[(2E)-2-(2-but-2-ynylsulfanyl-1-nitro-ethylidene)imidazolidin-1-yl]methyl]-2-chloranyl-pyridine

Systemtic Name: 5-[[(2E)-2-(2-but-2-ynylsulfanyl-1-nitro-ethylidene)imidazolidin-1-yl]methyl]-2-chloranyl-pyridine Openeye Name: 5-[[(2E)-2-(2-but-2-ynylsulfanyl-1-nitro-ethylidene)imidazolidin-1-yl]methyl]-2-chloro-pyridine CAS Name: 5-[[(2E)-2-[2-(but-2-ynylthio)-1-nitroethylidene]-1-imidazolidinyl]methyl]-2-chloropyridine IUPAC Name: 5-[[(2E)-2-(2-but-2-ynylsulfanyl-1-nitroethylidene)imidazolidin-1-yl]methyl]-2-chloropyridine Traditional Name: 5-[[(2E)-2-[2-(but-2-ynylthio)-1-nitro-ethylidene]imidazolidin-1-yl]methyl]-2-chloro-pyridine Formula: C15H17ClN4O2S MolecularWeight: 352.83908

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCSCC(=C1NCCN1CC2=CN=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC#CCSC/C(=C\1/NCCN1CC2=CN=C(C=C2)Cl)/[N+](=O)[O-]

InChI

InChI=1S/C15H17ClN4O2S/c1-2-3-8-23-11-13(20(21)22)15-17-6-7-19(15)10-12-4-5-14(16)18-9-12/h4-5,9,17H,6-8,10-11H2,1H3/b15-13+